Diheptyl oxalate
TL;DR: Diheptyl oxalate (CAS 20442-03-9) is a chemical compound with molecular formula C16H30O4 and molecular weight 286.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diheptyl oxalate
Also Known As: Diheptyl oxalate, Diheptyloxalat, diheptyl ethanedioate, Oxalic acid diheptyl ester, diheptyl ethane-1,2-dioate
| Molecular Formula | C16H30O4 |
|---|---|
| Molecular Weight | 286.21 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 286.21442 |
| Heavy Atoms | 20 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 20442-03-9 |
|---|---|
| SMILES | CCCCCCCOC(=O)C(=O)OCCCCCCC |
| InChIKey | BODADHIQAXIHKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diheptyl oxalate (CAS 20442-03-9), with molecular formula C16H30O4 and molecular weight 286.21 g/mol. IUPAC: diheptyl oxalate.
Chemical Property Profile of Diheptyl oxalate
Property Insights of Diheptyl oxalate
The XLogP value of 6.2 indicates that Diheptyl oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diheptyl oxalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diheptyl oxalate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diheptyl oxalate?
The CAS number of Diheptyl oxalate is 20442-03-9.
What is the molecular formula of Diheptyl oxalate?
The molecular formula of Diheptyl oxalate is C16H30O4.
What is the molecular weight of Diheptyl oxalate?
The molecular weight of Diheptyl oxalate is 286.21 g/mol.
Where can I buy Diheptyl oxalate?
You can request a quote for Diheptyl oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diheptyl oxalate?
Yes, KEHONG BIO provides custom synthesis services for Diheptyl oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.